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Title: Materials Data on TiSbRu by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1205673· OSTI ID:1205673

TiRuSb is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ti is bonded to four equivalent Ru and six equivalent Sb atoms to form a mixture of distorted corner and face-sharing TiSb6Ru4 tetrahedra. All Ti–Ru bond lengths are 2.67 Å. All Ti–Sb bond lengths are 3.08 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Ti and four equivalent Sb atoms. All Ru–Sb bond lengths are 2.67 Å. Sb is bonded in a 10-coordinate geometry to six equivalent Ti and four equivalent Ru atoms.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1205673
Report Number(s):
mp-31458
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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